1-(3-methylsulfanylpropyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(3-methylsulfanylpropyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-(3-methylsulfanylpropyl)-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-[3-(methylthio)propyl]-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(3-methylsulfanylpropyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-[3-(methylthio)propyl]-3-(5-morpholinosulfonyl-2-piperidino-phenyl)thiourea Formula: C20H32N4O3S3 MolecularWeight: 472.68808

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCC3

Isomeric SMILES

CSCCCNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCC3

InChI

InChI=1S/C20H32N4O3S3/c1-29-15-5-8-21-20(28)22-18-16-17(30(25,26)24-11-13-27-14-12-24)6-7-19(18)23-9-3-2-4-10-23/h6-7,16H,2-5,8-15H2,1H3,(H2,21,22,28)